Notice bibliographique
- Notice
Type(s) de contenu et mode(s) de consultation : Texte noté. Image fixe : sans médiation
Auteur(s) : Silwal, Indira
Titre(s) : Charecterization of unknown chemicals [Texte imprimé] : using gas chromatography/fourier transform ion cyclotron resonance mass spectrometry and AB-initio calculations / Indira Silwal
Publication : Saarbrücken : Verlag Dr. Müller, 2010
Description matérielle : 1 vol. (X-141 p.) : ill. ; 22 cm
Note(s) : Bibliogr. p. 97-100
The major goal of this book was to combine modern mass spectral techniques and advanced
ab-initio molecular orbital calculations for analytical characterization of complex
sample mixtures. Multidimensional mass spectral techniques and theoretical molecular
modeling approaches were developed to identify disinfection by-products (DBPs) that
were present in drinking water samples from local sources. Analogous methodologies
that utilized thermochemical analysis, including both experimental and theoretical
calculations, were employed to improve analytical resolution and identify components
of a complex petroleum mixture. In the process of developing these multidimensional
methods, we were able to address challenges such as solvent contamination that are
associated with identification of DBPs using conventional methods. Moreover, we were
able to develop a complementary theoretical method that utilizes proton transfer (PT)
energy profiles for proton affinity (PA) determinations
Sujet(s) : Chimie analytique
Indice(s) Dewey :
543 (23e éd.) = Chimie analytique
Identifiants, prix et caractéristiques : ISBN 978-3-639-14160-3. - ISBN 3-639-14160-1 (br.)
Identifiant de la notice : ark:/12148/cb42779919g
Notice n° :
FRBNF42779919
(notice reprise d'un réservoir extérieur)